SCHEMBL13615130

SCHEMBL13615130

COc1cc(N=Nc2c(SOOO)cc3cc(S(=O)(=O)O)c(N)cc3c2O)c(OC)cc1N=Nc1ccc2ccc(SOOO)cc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.46
ENPP2 Q13822 10/20 0.44
PHLPP2 Q6ZVD8 1/20 0.41
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
MAPK1 P28482 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
THRB P10828 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
APEX1 P27695 1/20 0.35
BRCA1 P38398 1/20 0.35
RECQL P46063 1/20 0.35
BLM P54132 1/20 0.35
SLC10A1 Q14973 1/20 0.35
HSD17B10 Q99714 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13615148 0.93 ENPP2 (0.46) PTPN11ENPP2PHLPP2MEN1ALDH1A1
SCHEMBL14259342 0.91 PHLPP2 (0.42) PTPN11ENPP2PHLPP2MEN1ALDH1A1
SCHEMBL13860946 0.90 ENPP2 (0.46) PTPN11ENPP2PHLPP2MEN1ALDH1A1
SCHEMBL13615143 0.89 ENPP2 (0.48) PTPN11ENPP2PHLPP2MEN1ALDH1A1
SCHEMBL13615190 0.89 PHLPP2 (0.46) PTPN11ENPP2PHLPP2MEN1ALDH1A1
SCHEMBL12568511 0.88 ENPP2 (0.42) PTPN11ENPP2PHLPP2MEN1ALDH1A1
SCHEMBL13860923 0.87 ENPP2 (0.43) PTPN11ENPP2PHLPP2MEN1ALDH1A1
SCHEMBL13615160 0.86 ENPP2 (0.44) PTPN11ENPP2PHLPP2PTPN1SENP2
SCHEMBL13615140 0.86 PTPN11 (0.45) PTPN11ENPP2PHLPP2MEN1ALDH1A1
SCHEMBL13860879 0.86 PHLPP2 (0.47) PTPN11ENPP2PHLPP2MEN1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275742-A1 COLORING MATTER FOR ANISOTROPIC COLORING MATTER FILM, COMPOSITION COMPRISING SAID COLORING MATTER, ANISOTROPIC COLORING MATTER FILM, AND POLARIZING ELEMENT MITSUBISHI CHEMICAL CORPORATION (JP) 2009-11-05 US disclosed